CHEBI:70956 - N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
ChEBI ID CHEBI:70956
ChEBI ASCII Name N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine
Definition An N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine in which the acyl group has 27 carbons and 0 double bonds and is 2-hydroxylated.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Alan Bridge
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C49H101N2O8P
Net Charge 0
Average Mass 877.30860
Monoisotopic Mass 876.72956
InChI InChI=1S/C49H101N2O8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-31-34-37-40-47(53)49(55)50-45(43-59-60(56,57)58-42-41-51(4,5)6)48(54)46(52)39-36-33-30-28-27-29-32-35-38-44(2)3/h44-48,52-54H,7-43H2,1-6H3,(H-,50,55,56,57)/t45-,46+,47?,48-/m0/s1
InChIKey YZOUWIXDXMGCLC-YKHQHKJGSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)N[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)[C@H](O)[C@H](O)CCCCCCCCCCC(C)C
ChEBI Ontology
Outgoing N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70956) has functional parent 15-methylhexadecaphytosphingosine (CHEBI:70968)
N-(2-hydroxyheptacosanoyl)-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70956) is a N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine (CHEBI:70776)
Synonym Source
4-hydroxy-N-(2-hydroxyheptacosanoyl)-15-methylhexadecasphinganine-1-phosphocholine ChEBI
Last Modified
26 November 2012